SCHEMBL440959

SCHEMBL440959

FC(F)(F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.58
IDO1 P14902 2/20 0.50
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.47
ADRB1 P08588 1/20 0.44
MAPT P10636 1/20 0.42
RAPGEF4 Q8WZA2 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGAV P06756 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HIF1A Q16665 1/20 0.40
TXNRD1 Q16881 1/20 0.40
TXNRD3 Q86VQ6 1/20 0.40
TXNRD2 Q9NNW7 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13567133 0.89 CES2 (0.50) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL9482063 0.89 RXRA (0.54) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL2095504 0.86 CES2 (0.48) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL4461544 0.86 CES2 (0.48) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL13866628 0.86 RXRA (0.52) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL29121448 0.86 CES2 (0.48) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL25489518 0.83 CES2 (0.52) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL2097545 0.83 CES2 (0.46) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL25436753 0.83 CES2 (0.46) CES2IDO1TSHRALDH1A1ADRB1
SCHEMBL22861023 0.83 GABRB2 (0.52) CES2IDO1TSHRALDH1A1ADRB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 274 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116444470-B Dicarboxylic acid di-DDMP ester compound, preparation method and application 河南中烟工业有限责任公司 2025-04-04 CN claimed
CN-117199535-A Electrolyte, electrochemical device and electronic device 远景睿泰动力技术(上海)有限公司 2023-12-08 CN claimed
CN-116444470-A Dicarboxylic acid di-DDMP ester compound, preparation method and application 河南中烟工业有限责任公司 2023-07-18 CN claimed
US-10961125-B2 SP2 carbon-containing composition, graphene quantum dot-containing composition, methods of manufacturing thereof, and method of peeling graphite TOKYO INSTITUTE OF TECHNOLOGY (JP) 2021-03-30 US claimed
US-20210079534-A1 METHOD, CELL, AND ELECTROLYTE FOR DINITROGEN CONVERSION MONASH UNIVERSITY (AU) 2021-03-18 US claimed
US-20190047868-A1 SP2 CARBON-CONTAINING COMPOSITION, GRAPHENE QUANTUM DOT-CONTAINING COMPOSITION, METHODS OF MANUFACTURING THEREOF, AND METHOD OF PEELING GRAPHITE TOKYO INSTITUTE OF TECHNOLOGY (JP) 2019-02-14 US claimed
CN-102482297-B Fluorine silicon ethyl-acetylene base pentacene compound and composition with and production and preparation method thereof 3M INNOVATIVE PROPERTIES CO. (US) 2015-12-09 CN claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-8512935-B2 Functionalized perfluoropolyether material as a hydrophobic coating HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2013-08-20 US claimed
WO-2010138807-A1 FLUORINATED SILYLETHYNYL PENTACENE COMPOUNDS AND COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-12-02 WO claimed
US-6998450-B1 Method for preparing a homo-and co-polymers by polymerization of cyclic olefin compounds using fluorine-containing aromatic hydrocarbon compound as catalyst activator KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2006-02-14 US claimed
US-6713214-B2 ORGANIC MATERIAL INCLUDING CARBON HAVING A CONJUGATE ELECTRON CLOUD AND COUPLED WITH AN ELECTRON ATTRACTIVE GROUP OR A MATERIAL OBTAINED BY BAKING A FLUOROCARBON POLYMER OR GRAPHITE FLUORIDE SANYO ELECTRIC CO., LTD. (JP) 2004-03-30 US claimed
US-20020090550-A1 Organic material including carbon having a conjugate electron cloud and coupled with an electron attractive group or a material obtained by baking a fluorocarbon polymer or graphite fluoride SANYO ELECTRIC CO., LTD. (JP) 2002-07-11 US claimed
US-4079090-A Preparation of trichloromethyl-trifluoro methyl-benzenes BAYER AKTIENGESELLSCHAFT (DT) 1978-03-14 US claimed
US-20250316763-A1 ELECTROLYTES FOR REACTIVE ANODE BATTERIES TOYOTA MOTOR ENGINEERING & MANUFACTURING NORTH AMERICA, INC. (US) 2025-10-09 US disclosed
US-20250185456-A1 ELECTROLUMINESCENT DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2025-06-05 US disclosed
US-20250147039-A1 Compounds for complexation of rare earth elements and/or s-, p-, d- block metals, their coordination compounds, peptide conjugates, method of their preparation and use thereof Ustav Organicke Chemie A Biochemie AV CR v.v.i. (CZ) 2025-05-08 US disclosed
WO-2000000811-A2 METHOD AND APPARATUS FOR DETERMINATION OF CARBON-HALOGEN COMPOUNDS AND APPLICATIONS THEREOF SAN DIEGO STATE UNIVERSITY FOUNDATION (US) 2000-01-06 WO disclosed
WO-1999014256-A1 PHOTORESIST COMPOSITIONS COMPRISING POLYCYCLIC POLYMERS WITH ACID LABILE PENDANT GROUPS THE B.F. GOODRICH COMPANY (US) 1999-03-25 WO disclosed
US-4079090-A Preparation of trichloromethyl-trifluoro methyl-benzenes BAYER AKTIENGESELLSCHAFT (DT) 1978-03-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250147039-A1 Compounds for complexation of rare earth elements and/or s-, p-, d- block metals, their coordination compounds, peptide conjugates, method of their preparation and use thereof SCLY, CD79B, CSTB CES2 4423/4885IDO1 3460/4885TSHR 1403/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.